| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | C=3N(C)c4ccccc4\C(=C\c1[n+](CC(C)=O)c2c(s1)cccc2)C=3 |
| InChI | InChI | 1.03 | InChI=1S/C21H19N2OS/c1-15(24)14-23-19-9-5-6-10-20(19)25-21(23)13-16-11-12-22(2)18-8-4-3-7-17(16)18/h3-13H,14H2,1-2H3/q+1 |
| InChIKey | InChI | 1.03 | MNJLWFGXGDINRC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN1C=C\C(=C/c2sc3ccccc3[n+]2CC(C)=O)c4ccccc14 |
| SMILES | CACTVS | 3.385 | CN1C=CC(=Cc2sc3ccccc3[n+]2CC(C)=O)c4ccccc14 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)C[n+]1c2ccccc2sc1/C=C/3\C=CN(c4c3cccc4)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)C[n+]1c2ccccc2sc1C=C3C=CN(c4c3cccc4)C |
